N8-(4-azanylcyclohexyl)-9-cyclopentyl-N2-piperidin-4-yl-6-prop-2-enyl-purine-2,8-diamine

Systemtic Name: N8-(4-azanylcyclohexyl)-9-cyclopentyl-N2-piperidin-4-yl-6-prop-2-enyl-purine-2,8-diamine Openeye Name: 6-allyl-N8-(4-aminocyclohexyl)-9-cyclopentyl-N2-(4-piperidyl)purine-2,8-diamine CAS Name: N8-(4-aminocyclohexyl)-9-cyclopentyl-N2-(4-piperidinyl)-6-prop-2-enylpurine-2,8-diamine IUPAC Name: 8-N-(4-aminocyclohexyl)-9-cyclopentyl-2-N-piperidin-4-yl-6-prop-2-enylpurine-2,8-diamine Traditional Name: [6-allyl-8-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-2-yl]-(4-piperidyl)amine Formula: C24H38N8 MolecularWeight: 438.61212

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C2C(=NC(=N1)NC3CCNCC3)N(C(=N2)NC4CCC(CC4)N)C5CCCC5

Isomeric SMILES

C=CCC1=C2C(=NC(=N1)NC3CCNCC3)N(C(=N2)NC4CCC(CC4)N)C5CCCC5

InChI

InChI=1S/C24H38N8/c1-2-5-20-21-22(31-23(29-20)27-18-12-14-26-15-13-18)32(19-6-3-4-7-19)24(30-21)28-17-10-8-16(25)9-11-17/h2,16-19,26H,1,3-15,25H2,(H,28,30)(H,27,29,31)